Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 5/20 | 0.39 |
| ▸ | RAB9A | P51151 | 4/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.39 |
| ▸ | POLB | P06746 | 3/20 | 0.39 |
| ▸ | MAPT | P10636 | 2/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.36 |
| ▸ | HPGD | P15428 | 3/20 | 0.36 |
| ▸ | CHRNB2 | P17787 | 4/20 | 0.36 |
| ▸ | CHRNB4 | P30926 | 4/20 | 0.36 |
| ▸ | CHRNA3 | P32297 | 4/20 | 0.36 |
| ▸ | CHRNA4 | P43681 | 4/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | AHR | P35869 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | HTT | P42858 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.35 |
| ▸ | GAA | P10253 | 1/20 | 0.34 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.34 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL28376874 | 0.79 | NPC1 (0.35) | NPC1RAB9ASMN1; SMN2POLBMAPT | |
| SCHEMBL28376877 | 0.79 | NPC1 (0.35) | NPC1RAB9ASMN1; SMN2POLBMAPT | |
| SCHEMBL23504461 | 0.78 | POLB (0.36) | NPC1RAB9ASMN1; SMN2POLBMAPT | |
| SCHEMBL20764461 | 0.78 | ALDH1A1 (0.39) | POLBMAPTALDH1A1HPGDKDM4E | |
| SCHEMBL31311141 | 0.77 | STAT3 (0.36) | NPC1RAB9ASMN1; SMN2POLBMAPT | |
| SCHEMBL20786864 | 0.77 | SMN1; SMN2 (0.45) | NPC1RAB9ASMN1; SMN2POLBMAPT | |
| SCHEMBL31311063 | 0.76 | SMN1; SMN2 (0.42) | NPC1RAB9ASMN1; SMN2POLBMAPT | |
| SCHEMBL31311112 | 0.76 | MAPT (0.41) | NPC1RAB9ASMN1; SMN2POLBMAPT | |
| SCHEMBL20786866 | 0.75 | SMN1; SMN2 (0.44) | NPC1RAB9ASMN1; SMN2POLBMAPT | |
| SCHEMBL20764511 | 0.75 | ALDH1A1 (0.42) | NPC1RAB9ASMN1; SMN2POLBMAPT |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2019038405-A1 | NOVEL CYSTOBACTAMIDE DERIVATIVES | Helmholtz-Zentrum für Infektionsforschung GmbH (DE) | 2019-02-28 | — | — | WO | disclosed |